NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 506 L 4.3332 8.1849 120.6403 54.7524 43.0221 176.3327 507 Q 4.4026 8.4555 122.3545 53.3514 30.3652 174.3414 508 F 4.4991 9.2163 124.2415 58.1837 40.8793 174.0086 509 A 4.5588 7.9313 130.4511 50.4560 21.3057 174.5035 510 Y 4.7092 7.1478 117.8091 55.6017 41.1370 173.8876 511 K 4.1366 8.8181 122.9234 55.3915 32.8846 175.6692 512 D 4.2298 8.5914 126.0997 54.5232 41.0959 176.2120 513 P 4.2799 0.0000 0.0000 64.7598 31.6076 175.4383 514 E 4.6788 6.9806 114.6852 55.0336 32.4000 175.0086 515 K 4.2277 8.5145 118.3484 57.6083 33.2007 175.7070 516 N 4.2362 8.7367 113.9697 54.0168 35.9408 174.6168 517 W 4.1798 8.4018 127.6319 57.2126 31.5593 174.9154 518 N 4.4631 7.7774 124.6992 52.3515 37.7348 175.4037 519 R 4.2763 8.4732 126.2850 59.0197 30.4457 178.7682 520 N 4.4951 8.2011 115.7524 55.6619 39.1710 175.9273 521 S 4.1646 8.0957 112.6238 59.9586 63.3637 173.6046 522 V 4.5070 7.5522 121.3294 61.0671 31.9913 175.2069 523 K 4.0984 8.8230 128.6124 58.9887 32.6187 175.6705 524 G 3.8130 8.0611 102.6620 43.7047 0.0000 172.4864 525 L 4.5623 8.5999 118.6620 54.4815 42.4916 178.2106 526 V 3.5322 8.7269 123.2030 66.1880 31.5012 178.2409 527 A 4.0280 8.0156 121.0899 55.0254 18.2111 178.2908 528 S 4.5366 8.1052 109.7854 59.3523 63.2210 174.6911 529 L 4.6690 7.9773 119.6374 54.2039 42.3390 175.9554 530 I 4.8393 7.5861 111.9664 58.9867 40.6468 174.8263 531 N 4.8659 8.9936 122.4835 51.5378 41.3468 173.5734 532 V 3.8733 8.3711 127.1130 62.9112 31.5948 176.2774 533 K 4.1804 8.7192 127.8427 59.0040 32.8896 177.2302 534 D 4.5463 7.8122 119.4775 52.5108 43.8518 175.2284 535 N 4.2847 9.0457 125.0686 56.3284 38.6985 176.8714 536 S 4.3587 8.5249 111.5389 59.9158 63.3903 175.2459 537 T 4.4111 8.0917 111.7600 61.7829 68.9595 176.0521 538 A 3.9965 7.7498 124.9628 55.7232 18.3584 179.7591 539 T 3.7988 7.9602 113.5008 66.7671 68.5240 176.4295 540 A 4.0305 7.9671 122.0007 55.3186 18.4787 179.5723 541 L 4.0973 8.1244 117.5112 57.7994 41.5670 179.3192 542 E 3.9517 8.5415 119.7106 59.3428 29.3468 179.1390 543 V 3.6071 7.5024 117.0086 65.6435 31.6349 177.8316 544 V 3.6937 8.0164 117.5481 66.0880 31.7307 177.6353 545 A 3.7545 8.3573 120.5710 53.4746 18.7346 178.3855 546 G 3.5995 8.9108 107.7254 46.4370 0.0000 176.4568 547 E 4.2269 8.6413 120.6382 58.3670 29.8119 179.0247 548 R 4.2825 7.8308 118.4178 57.7382 30.4393 178.4878 549 L 3.7478 7.5814 118.4711 57.3015 41.5596 177.8939 550 Y 5.1058 7.1038 113.5999 57.6765 38.6259 176.1875 551 N 4.7692 8.1474 118.0588 53.4418 40.2697 173.9839 552 V 4.3897 8.4270 121.6415 61.2236 33.8426 174.5444 553 V 4.6060 8.6380 128.4334 61.9091 33.1888 175.0930 554 V 5.0259 8.5850 120.0928 59.4852 36.4084 176.3815 555 D 4.4624 9.0289 121.6002 56.4220 40.2977 176.5965 556 T 5.8544 7.8160 107.0517 57.4520 72.2360 174.1989 557 E 3.9729 8.7580 119.8456 59.2384 29.3940 179.4411 558 V 3.5811 7.6781 119.1335 66.2063 31.7293 177.8917 559 T 4.0392 7.8647 115.0818 66.5550 68.2702 176.3130 560 A 3.9729 8.0979 122.6504 55.1389 18.3873 179.5624 561 K 3.8747 8.1900 117.9992 59.7211 32.2059 179.1583 562 K 4.0114 8.2963 118.7408 59.2924 31.9493 179.4012 563 L 3.8049 8.0966 119.2838 57.8360 41.3707 179.5602 564 L 4.0534 7.8278 117.5186 57.7934 41.5994 179.0571 565 E 4.2761 8.2087 117.5230 58.0193 29.7504 177.5766 566 K 4.5183 8.1328 114.2926 55.8075 33.8600 176.8909 567 G 3.9430 8.3777 108.2268 44.6228 0.0000 173.8084 568 E 3.9636 8.0990 118.0274 56.9319 27.1654 175.1327 569 L 4.1795 7.8469 116.4921 55.2088 42.4470 178.0075 570 K 4.3542 8.8038 120.6408 56.9725 32.5482 176.1153 571 R 4.5081 7.4739 114.0861 54.6453 32.0691 174.1786 572 R 4.0789 8.2941 118.7454 56.4100 30.4644 174.9550 573 Y 4.7330 8.5245 122.0322 56.4252 41.2157 174.7490 574 T 4.6562 8.4555 118.7047 62.0612 70.9295 173.2565 575 I 4.8027 8.3929 127.0484 59.5893 39.7321 175.3475 576 I 4.1805 8.8408 128.4447 59.1159 38.5084 173.0168 577 P 4.8244 0.0000 0.0000 61.6685 31.9464 176.9472 578 L 4.0646 8.8837 126.6757 57.6309 41.9243 178.2979 579 N 4.5828 8.3776 114.7658 54.0024 37.8684 177.1993 580 K 4.3329 7.8680 116.8428 56.3817 34.7964 176.4474 581 I 3.4944 7.6135 119.1857 61.3980 38.0985 175.9874 582 S 4.3845 7.9798 120.8810 56.4135 62.8467 172.7890 583 A 4.2748 8.2284 128.1890 51.8553 18.9247 178.4197 584 R 4.3524 8.1848 120.8369 55.0550 29.0526 176.2743 585 C 4.5781 8.0242 119.5267 58.9312 29.5623 173.2962 586 I 3.8064 8.0757 122.5073 61.4418 37.1201 176.3430 587 A 4.2328 8.6312 128.7956 51.0011 19.5201 176.3761 588 P 4.2284 0.0000 0.0000 65.8391 31.3509 178.8870 589 E 3.9663 8.1668 117.5671 59.4761 29.5525 178.8758 590 T 3.9317 7.8036 115.4502 66.5029 68.5826 176.2036 591 L 4.1423 8.0525 122.2165 58.1209 42.1528 178.8580 592 R 4.0402 8.2030 118.7462 59.5660 30.1443 178.6533 593 V 3.5537 8.0191 117.7336 65.8686 31.5222 177.7386 594 A 3.8231 8.0804 120.5576 55.3172 18.0737 179.6166 595 Q 3.8733 8.3586 116.8729 59.2524 28.5644 178.9065 596 N 4.3211 8.0231 116.2707 55.6439 38.5492 177.0515 597 L 4.1292 7.4416 121.1185 57.3172 42.4405 177.7181 598 V 4.2016 7.8674 107.7688 60.2523 33.5284 176.4489 599 G 3.9463 8.4094 109.1594 45.0268 0.0000 173.2286 600 P 4.2396 0.0000 0.0000 65.0755 31.5646 177.3520 601 D 4.5133 8.0511 117.8227 56.3398 41.1485 176.2385 602 N 5.1076 8.2144 115.4891 52.7824 40.2508 174.6811 603 V 4.9890 7.3456 118.2892 60.6534 34.4781 173.9617 604 H 5.0901 9.2998 120.4906 53.7354 33.7986 173.1942 605 V 3.9065 8.6545 121.1209 62.6101 32.2495 176.8398 606 A 4.0829 8.9451 129.3341 55.3926 18.0414 179.6290 607 L 3.9293 8.1017 118.5280 58.2693 41.9006 178.5921 608 S 4.4488 8.0842 111.7732 59.6005 63.4546 175.0550 609 L 4.4391 7.9524 122.6529 54.1472 41.9433 175.7550 610 V 4.9253 6.9446 111.7128 59.5871 35.2471 174.8027 611 D 4.8843 8.8559 123.3316 53.1840 43.5853 174.9217 612 Y 4.9066 7.2235 116.3242 56.2478 40.4668 173.9091 613 K 4.1440 8.4891 120.2171 55.9030 33.0529 176.7102 614 P 4.3758 0.0000 0.0000 65.5871 31.0065 178.6864 615 E 4.1126 8.2621 115.0788 58.7687 29.8301 178.0551 616 L 4.3465 8.2068 118.8290 54.7039 41.7225 177.8659 617 Q 4.0232 7.9754 120.8513 59.5332 29.3861 178.4499 618 K 4.3023 8.1234 118.5494 59.3907 32.5988 179.6835 619 G 3.7780 7.9456 105.1402 46.2191 0.0000 175.0425 *621 E 4.2522 8.2770 121.5150 56.0507 31.5031 178.1522 622 F 4.1550 8.1066 119.3618 61.2332 39.6585 176.4912 623 V 3.0899 7.6038 119.0668 64.7800 31.2238 176.4542 624 F 4.7690 7.8065 114.1706 57.1024 40.8784 175.7233 625 G 3.9482 8.2516 109.9070 45.7943 0.0000 174.7737 626 T 4.5383 7.6001 107.5197 61.0433 69.6617 173.5464 627 T 4.7612 7.3081 118.0017 62.1622 72.8295 173.0566 628 F 5.1957 8.9245 123.8193 56.6684 41.5216 174.8005 629 V 4.9909 9.2353 121.5504 61.5383 34.1199 174.3740 630 C 6.0600 9.2696 124.9942 56.9250 31.3317 174.7713 631 N 4.6346 8.8585 118.5014 55.0167 38.0068 174.7896 632 N 4.8586 7.9655 117.0731 52.6884 41.2215 175.3100 *634 D 4.4528 9.1977 116.0114 54.3382 42.7167 177.1125 635 N 4.2901 8.7104 116.4387 56.0338 38.3271 177.3250 636 A 3.9450 8.0150 122.2737 55.1418 18.5359 179.9186 637 K 3.7495 7.4069 116.3351 59.3272 31.9491 179.5012 638 K 3.9168 7.6336 117.7442 59.4372 32.0078 179.3603 639 V 3.5785 7.9002 118.1013 65.9446 31.3111 177.8015 640 A 4.4775 7.8389 120.5854 54.2461 18.3302 178.7384 641 F 4.5318 7.6799 112.0214 56.2565 39.9855 175.9440 642 D 4.4680 7.4649 120.5687 53.8766 41.4812 177.2946 643 K 4.0291 8.7589 125.5384 59.7435 32.5934 177.9254 644 R 4.3419 8.4044 117.0545 57.0032 31.2994 177.3361 645 I 4.4820 7.4417 119.8067 61.3219 37.9474 175.7145 *647 T 4.1498 8.2607 122.5877 63.9700 70.2772 173.2099 648 R 4.3255 8.6144 125.2543 57.8020 31.1297 175.0270 649 T 5.3432 9.2193 121.7639 61.8927 73.0260 172.9061 650 V 5.0893 9.0307 125.7700 61.3143 34.6470 175.1129 651 T 4.9416 9.0390 118.0122 60.7667 70.2365 175.8792 652 L 4.0108 8.4704 122.3022 57.5776 41.6795 178.9282 653 G 3.7014 8.0702 105.4688 46.2340 0.0000 174.3825 654 G 3.9435 8.4991 108.6825 45.2285 0.0000 173.1877 655 D 4.6737 8.1327 119.6221 53.3854 42.4936 175.5307 656 V 4.8072 7.9259 121.1125 61.1224 34.1752 174.7187 657 F 4.8618 9.3402 125.6944 55.7636 42.4131 173.4747 658 D 4.8059 8.7261 122.9842 51.8544 43.0148 173.7536 659 P 4.1877 0.0000 0.0000 64.4998 31.7579 176.2600 660 H 4.5657 8.6306 120.5177 55.7949 28.9924 173.6621 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 506 L 8.18 4.33 0.00 1.71 1.74 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 507 Q 8.46 4.40 0.00 2.18 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.90 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 508 F 9.22 4.50 0.00 2.94 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 509 A 7.93 4.56 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 510 Y 7.15 4.71 0.00 2.64 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 511 K 8.82 4.14 0.00 1.74 1.73 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.31 1.32 7.81 512 D 8.59 4.23 0.00 2.55 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 513 P 0.00 4.28 0.00 1.63 2.04 0.00 2.20 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.53 0.00 514 E 6.98 4.68 0.00 2.27 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 515 K 8.51 4.23 0.00 1.93 1.90 0.00 1.76 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.51 7.81 516 N 8.74 4.24 0.00 2.95 2.98 0.00 0.00 6.90 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 517 W 8.40 4.18 0.00 3.60 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 518 N 7.78 4.46 0.00 2.62 2.27 0.00 0.00 7.22 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 519 R 8.47 4.28 0.00 2.01 2.15 0.00 3.27 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.81 0.00 520 N 8.20 4.50 0.00 2.68 2.93 0.00 0.00 7.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 521 S 8.10 4.16 0.00 4.13 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 522 V 7.55 4.51 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 1.06 0.00 0.00 523 K 8.82 4.10 0.00 1.87 1.87 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.53 7.81 524 G 8.06 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 525 L 8.60 4.56 0.00 1.84 1.73 1.19 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 526 V 8.73 3.53 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 527 A 8.02 4.03 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 528 S 8.11 4.54 0.00 4.04 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 529 L 7.98 4.67 0.00 1.77 1.74 0.98 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 530 I 7.59 4.84 1.84 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.68 1.08 0.00 0.00 531 N 8.99 4.87 0.00 2.82 2.69 0.00 0.00 6.99 8.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 532 V 8.37 3.87 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.89 0.00 0.00 533 K 8.72 4.18 0.00 1.65 1.82 0.00 1.79 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.60 1.46 7.81 534 D 7.81 4.55 0.00 2.59 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 535 N 9.05 4.28 0.00 2.87 2.87 0.00 0.00 6.86 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 536 S 8.52 4.36 0.00 3.98 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 537 T 8.09 4.41 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 538 A 7.75 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 539 T 7.96 3.80 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 540 A 7.97 4.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 541 L 8.12 4.10 0.00 1.86 1.79 0.80 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 542 E 8.54 3.95 0.00 2.06 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 543 V 7.50 3.61 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.06 0.00 0.00 544 V 8.02 3.69 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.04 0.00 0.00 545 A 8.36 3.75 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 546 G 8.91 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 547 E 8.64 4.23 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 548 R 7.83 4.28 0.00 1.78 1.81 0.00 2.70 0.00 0.00 2.74 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.41 0.00 549 L 7.58 3.75 0.00 0.35 0.95 0.78 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 550 Y 7.10 5.11 0.00 2.93 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 551 N 8.15 4.77 0.00 2.89 2.75 0.00 0.00 6.51 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 552 V 8.43 4.39 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.14 0.00 0.00 553 V 8.64 4.61 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.91 0.00 0.00 554 V 8.59 5.03 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 1.00 0.00 0.00 555 D 9.03 4.46 0.00 2.67 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 556 T 7.82 5.85 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 557 E 8.76 3.97 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 558 V 7.68 3.58 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.93 0.00 0.00 559 T 7.86 4.04 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 560 A 8.10 3.97 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 561 K 8.19 3.87 0.00 1.91 2.00 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.49 7.81 562 K 8.30 4.01 0.00 2.18 1.90 0.00 1.99 0.00 0.00 2.04 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.74 7.81 563 L 8.10 3.80 0.00 1.84 1.69 0.87 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 564 L 7.83 4.05 0.00 1.76 1.76 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 565 E 8.21 4.28 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 566 K 8.13 4.52 0.00 1.72 1.70 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.32 7.81 567 G 8.38 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 568 E 8.10 3.96 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.26 0.00 569 L 7.85 4.18 0.00 1.82 1.97 1.09 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 570 K 8.80 4.35 0.00 1.84 1.88 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.44 7.81 571 R 7.47 4.51 0.00 1.70 1.78 0.00 2.69 0.00 0.00 2.93 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.64 0.00 572 R 8.29 4.08 0.00 1.78 1.83 0.00 3.18 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 573 Y 8.52 4.73 0.00 3.03 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 574 T 8.46 4.66 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 575 I 8.39 4.80 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.57 0.88 0.00 0.00 576 I 8.84 4.18 1.81 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.65 0.80 0.00 0.00 577 P 0.00 4.82 0.00 2.12 2.25 0.00 3.28 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 578 L 8.88 4.06 0.00 1.63 1.76 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 579 N 8.38 4.58 0.00 2.77 3.03 0.00 0.00 6.66 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 580 K 7.87 4.33 0.00 1.65 1.78 0.00 1.74 0.00 0.00 1.60 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.28 1.28 7.81 581 I 7.61 3.49 1.79 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.32 0.89 0.00 0.00 582 S 7.98 4.38 0.00 3.76 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 583 A 8.23 4.27 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 584 R 8.18 4.35 0.00 1.80 1.90 0.00 3.20 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 585 C 8.02 4.58 0.00 2.84 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 586 I 8.08 3.81 1.64 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.17 0.77 0.00 0.00 587 A 8.63 4.23 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 588 P 0.00 4.23 0.00 2.19 2.15 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 589 E 8.17 3.97 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 590 T 7.80 3.93 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 591 L 8.05 4.14 0.00 2.00 1.93 1.06 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 592 R 8.20 4.04 0.00 2.03 2.10 0.00 3.15 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 593 V 8.02 3.55 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.98 0.00 0.00 594 A 8.08 3.82 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 595 Q 8.36 3.87 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 596 N 8.02 4.32 0.00 2.82 2.86 0.00 0.00 7.03 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 597 L 7.44 4.13 0.00 1.73 1.81 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 598 V 7.87 4.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.90 0.00 0.00 599 G 8.41 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 600 P 0.00 4.24 0.00 2.17 2.17 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 601 D 8.05 4.51 0.00 2.69 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 602 N 8.21 5.11 0.00 2.81 2.94 0.00 0.00 6.32 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 603 V 7.35 4.99 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.50 0.00 0.00 604 H 9.30 5.09 0.00 3.19 3.24 0.00 5.81 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 605 V 8.65 3.91 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.93 0.00 0.00 606 A 8.95 4.08 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 607 L 8.10 3.93 0.00 1.89 1.75 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 608 S 8.08 4.45 0.00 4.11 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 609 L 7.95 4.44 0.00 1.70 1.66 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 610 V 6.94 4.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.78 0.00 0.00 611 D 8.86 4.88 0.00 2.58 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 612 Y 7.22 4.91 0.00 2.93 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 613 K 8.49 4.14 0.00 1.92 1.82 0.00 1.72 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.51 7.81 614 P 0.00 4.38 0.00 2.18 2.12 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 615 E 8.26 4.11 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 616 L 8.21 4.35 0.00 1.89 1.71 1.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 617 Q 7.98 4.02 0.00 2.33 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.99 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 618 K 8.12 4.30 0.00 1.84 1.83 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.54 1.44 7.81 619 G 7.95 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *621 E 8.28 4.25 0.00 2.26 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.45 0.00 622 F 8.11 4.15 0.00 2.89 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 623 V 7.60 3.09 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 0.81 0.00 0.00 624 F 7.81 4.77 0.00 2.99 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 625 G 8.25 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 626 T 7.60 4.54 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 627 T 7.31 4.76 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 628 F 8.92 5.20 0.00 3.02 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 629 V 9.24 4.99 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.01 0.00 0.00 630 C 9.27 6.06 0.00 2.91 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 631 N 8.86 4.63 0.00 2.74 2.97 0.00 0.00 5.84 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 632 N 7.97 4.86 0.00 2.93 2.02 0.00 0.00 6.25 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *634 D 9.20 4.45 0.00 2.72 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 635 N 8.71 4.29 0.00 2.86 2.80 0.00 0.00 6.96 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 636 A 8.01 3.95 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 637 K 7.41 3.75 0.00 1.70 1.69 0.00 1.49 0.00 0.00 1.66 0.00 0.00 3.33 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.53 0.36 7.81 638 K 7.63 3.92 0.00 1.85 1.83 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.56 7.81 639 V 7.90 3.58 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.72 0.00 0.00 640 A 7.84 4.48 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 641 F 7.68 4.53 0.00 3.16 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 642 D 7.46 4.47 0.00 2.88 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 643 K 8.76 4.03 0.00 1.92 1.97 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 644 R 8.40 4.34 0.00 1.94 2.03 0.00 3.11 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 645 I 7.44 4.48 2.05 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.60 1.07 0.00 0.00 *647 T 8.26 4.15 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 648 R 8.61 4.33 0.00 1.86 1.81 0.00 3.19 0.00 0.00 3.27 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 649 T 9.22 5.34 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 650 V 9.03 5.09 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.96 0.00 0.00 651 T 9.04 4.94 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 652 L 8.47 4.01 0.00 1.73 1.81 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 653 G 8.07 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 654 G 8.50 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 655 D 8.13 4.67 0.00 2.72 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 656 V 7.93 4.81 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.88 0.00 0.00 657 F 9.34 4.86 0.00 3.01 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 658 D 8.73 4.81 0.00 2.60 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 659 P 0.00 4.19 0.00 1.65 1.76 0.00 3.48 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.44 0.00 660 H 8.63 4.57 0.00 3.11 3.15 0.00 5.88 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.